DI-2-PYRIDYLKETONE 4-CYCLOHEXYL-4-METHYL-3-THIOSEMICARBAZONE HYDROCHLORIDE

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H23N5S.ClH
Molecular Weight	389.945
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DI-2-PYRIDYLKETONE 4-CYCLOHEXYL-4-METHYL-3-THIOSEMICARBAZONE HYDROCHLORIDE

Structure Search

SMILES

Cl.CN(C1CCCCC1)C(=S)NN=C(C2=CC=CC=N2)C3=NC=CC=C3

InChI

InChIKey=GUBMTJGHYSVNRX-UHFFFAOYSA-N

InChI=1S/C19H23N5S.ClH/c1-24(15-9-3-2-4-10-15)19(25)23-22-18(16-11-5-7-13-20-16)17-12-6-8-14-21-17;/h5-8,11-15H,2-4,9-10H2,1H3,(H,23,25);1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C19H23N5S
Molecular Weight	353.484
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
TNFα expression 2 Target ID: TNFα expression Sources: https://www.ncbi.nlm.nih.gov/pubmed/27678372	Activator 1430
reactive oxygen species 8 Target ID: reactive oxygen species Sources: https://www.ncbi.nlm.nih.gov/pubmed/27678372	Activator 1430

PubMed

Title	Date	PubMed
The Metastasis Suppressor, N-MYC Downstream-regulated Gene-1 (NDRG1), Down-regulates the ErbB Family of Receptors to Inhibit Downstream Oncogenic Signaling Pathways.	2016 Jan 15	26534963

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:37:25 GMT 2023` Edited by `admin` on `Sat Dec 16 11:37:25 GMT 2023`
Record UNII	592GM24H49
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DI-2-PYRIDYLKETONE 4-CYCLOHEXYL-4-METHYL-3-THIOSEMICARBAZONE HYDROCHLORIDE

Common Name

English

DPC HYDROCHLORIDE

Common Name

English

HYDRAZINECARBOTHIOAMIDE, N-CYCLOHEXYL-2-(DI-2-PYRIDINYLMETHYLENE)-N-METHYL-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

1382469-40-0

Created by admin on Sat Dec 16 11:37:25 GMT 2023 , Edited by admin on Sat Dec 16 11:37:25 GMT 2023

PRIMARY

FDA UNII

592GM24H49

Created by admin on Sat Dec 16 11:37:25 GMT 2023 , Edited by admin on Sat Dec 16 11:37:25 GMT 2023

PRIMARY

PUBCHEM

57380303

Created by admin on Sat Dec 16 11:37:25 GMT 2023 , Edited by admin on Sat Dec 16 11:37:25 GMT 2023

PRIMARY

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ACTIVE MOIETY